null

SMILES: CN(C(=O)CNC(=O)\C=C\c1ccc(\C=C\c2ccncc2)nc1)c1ccc(Cl)c(COc2cccc3c(OCc4ccccn4)cc(C)nc23)c1Cl

InChI Key: InChIKey=RUKKAZMVBFPUDU-WBJPGKSWSA-N

PDB links: 2 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50150940   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
B2 bradykinin receptor (Homo sapiens (Human))	BDBM50150940 (CHEMBL3774617) Show SMILES CN(C(=O)CNC(=O)\C=C\c1ccc(\C=C\c2ccncc2)nc1)c1ccc(Cl)c(COc2cccc3c(OCc4ccccn4)cc(C)nc23)c1Cl Show InChI InChI=1S/C41H34Cl2N6O4/c1-27-22-37(52-25-31-6-3-4-19-45-31)32-7-5-8-36(41(32)48-27)53-26-33-34(42)14-15-35(40(33)43)49(2)39(51)24-47-38(50)16-11-29-10-13-30(46-23-29)12-9-28-17-20-44-21-18-28/h3-23H,24-26H2,1-2H3,(H,47,50)/b12-9+,16-11+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	0.360	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Agonist activity at bradykinin B2 receptor (unknown origin)				Citation and Details Article DOI: 10.1016/j.ejmech.2020.112948 BindingDB Entry DOI: 10.7270/Q2JW8JM8
					More data for this Ligand-Target Pair
B2 bradykinin receptor (Homo sapiens (Human))	BDBM50150940 (CHEMBL3774617) Show SMILES CN(C(=O)CNC(=O)\C=C\c1ccc(\C=C\c2ccncc2)nc1)c1ccc(Cl)c(COc2cccc3c(OCc4ccccn4)cc(C)nc23)c1Cl Show InChI InChI=1S/C41H34Cl2N6O4/c1-27-22-37(52-25-31-6-3-4-19-45-31)32-7-5-8-36(41(32)48-27)53-26-33-34(42)14-15-35(40(33)43)49(2)39(51)24-47-38(50)16-11-29-10-13-30(46-23-29)12-9-28-17-20-44-21-18-28/h3-23H,24-26H2,1-2H3,(H,47,50)/b12-9+,16-11+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	0.360	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Inhibition of human N-terminal His-tagged KDM4A (1 to 359 residues) expressed in Escherichia coli using biotin-H3K9me3 as substrate preincubated for ...				J Med Chem 59: 810-40 (2016) Article DOI: 10.1021/acs.jmedchem.5b00982 BindingDB Entry DOI: 10.7270/Q2XS5X8K
					More data for this Ligand-Target Pair